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1-[(4-methyl-2,6-dinitro-phenyl)amino]cyclohexane-1-carboxylic acid

1-[(4-methyl-2,6-dinitro-phenyl)amino]cyclohexane-1-carboxylic acid

Systemtic Name:1-[(4-methyl-2,6-dinitro-phenyl)amino]cyclohexane-1-carboxylic acid
Openeye Name:1-(4-methyl-2,6-dinitro-anilino)cyclohexanecarboxylic acid
CAS Name:1-(4-methyl-2,6-dinitroanilino)-1-cyclohexanecarboxylic acid
IUPAC Name:1-(4-methyl-2,6-dinitroanilino)cyclohexane-1-carboxylic acid
Traditional Name:1-(4-methyl-2,6-dinitro-anilino)cyclohexanecarboxylic acid
Formula: C14H17N3O6
MolecularWeight: 323.30128
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC2(CCCCC2)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC2(CCCCC2)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C14H17N3O6/c1-9-7-10(16(20)21)12(11(8-9)17(22)23)15-14(13(18)19)5-3-2-4-6-14/h7-8,15H,2-6H2,1H3,(H,18,19)


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